Chemical Compound

(5S)-5-[(2R,3R,4S,5R,6R)-5-[3-[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]sulfanyl-2-[[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]sulfanylcarbothioylamino]butanoyl]oxy-6-(acetyloxymethyl)-3-hydroxy-4-[(4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-5-[(1S)-1-[(2S)-2-methylbutanoyl]oxyethyl]oxan-2-yl]oxyoxan-2-yl]-2-amino-5-hydroxy-3,6-dioxocyclohexene-1-carboxylic acid

CAS Registry Number 101411-70-5
(5S)-5-[(2R,3R,4S,5R,6R)-5-[3-[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]sulfanyl-2-[[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]sulfanylcarbothioylamino]butanoyl]oxy-6-(acetyloxymethyl)-3-hydroxy-4-[(4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-5-[(1S)-1-[(2S)-2-methylbutanoyl]oxyethyl]oxan-2-yl]oxyoxan-2-yl]-2-amino-5-hydroxy-3,6-dioxocyclohexene-1-carboxylic acid 结构式
Primary record

(5S)-5-[(2R,3R,4S,5R,6R)-5-[3-[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]sulfanyl-2-[[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]sulfanylcarbothioylamino]butanoyl]oxy-6-(acetyloxymethyl)-3-hydroxy-4-[(4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-5-[(1S)-1-[(2S)-2-methylbutanoyl]oxyethyl]oxan-2-yl]oxyoxan-2-yl]-2-amino-5-hydroxy-3,6-dioxocyclohexene-1-carboxylic acid

库存
2,246 克
纯度
98.5 %
CAS
101411-70-5

化合物标识与属性

CAS
101411-70-5
PubChem CID
135554458
SMILES
CC[C@H](C)C(=O)O[C@@H](C)[C@]1([C@@H](OC(C[C@@H]1OC)O[C@H]2[C@H]([C@@H](O[C@@H]([C@H]2OC(=O)C(C(C)SC[C@@H](C(=O)O)NC(=O)C)NC(=S)SC[C@@H](C(=O)O)NC(=O)C)COC(=O)C)[C@]3(CC(=O)C(=N)C(=C3O)C(=O)O)O)O)C)O
Canonical SMILES
CC[C@H](C)C(=O)O[C@@H](C)[C@@]1(O)[C@H](C)OC(O[C@H]2[C@@H](O)[C@H]([C@@]3(O)CC(=O)C(=N)C(C(=O)O)=C3O)O[C@H](COC(C)=O)[C@H]2OC(=O)C(NC(=S)SC[C@H](NC(C)=O)C(=O)O)C(C)SC[C@H](NC(C)=O)C(=O)O)C[C@@H]1OC

名称与同义词

  • Paldimycin A
  • Antibiotic 273 A1-alpha
  • UNII-7HMD7M29RI
  • AC1MHWS1
  • 7HMD7M29RI
  • RefChem:1077053
  • Antibiotic 273a1.alpha.
  • C44H64N4O23S3
  • CID3034031
  • C44-H64-N4-O23-S3
  • LS-58980
  • Q27268305
  • 101411-70-5
  • 2-Amino-5-(3-O-(2,6-dideoxy-4-C-((1S)-1-hydroxyethyl)-3-O-methyl-alpha-L-lyxo-hexopyranosyl)-beta-D-allopyranosyl)-5-hydroxy-3,6-dioxo-1-cyclohexene-1-carboxylic acid, 4'-(3-(((2R)-2-acetamido-2-carboxyethyl)thio)-2-((dithiocarboxy)amino)butyrate), 6'-acetate, 4''-C-((2S)-2-methylbutyrate), S-ester with N-acetyl-L-cysteine
  • 2-Amino-5-(3-O-(2,6-dideoxy-4-C-((1S)-1-hydroxyethyl)-3-O-methyl-alpha-L-lyxo-hexopyranosyl)-beta-D-allopyranosyl)-5-hydroxy-3,6-dioxo-1-cyclohexene-1-carboxylic acid, 4'-(3-(((2R)-2-acetamido-2-carboxyethyl)thio)-2-((dithiocarboxy)amino)butyrate), 6'-acetate, 4'-C-((2S)-2-methylbutyrate), S-ester with N-acetyl-L-cysteine
  • L-Cysteine, N-acetyl-, (2-((2-(acetylamino)-2-carboxyethyl)thio)-1-carboxypropyl)carbamodithioate (ester), 4'-ester with 5-(6-O-acetyl-3-O-(2,6-dideoxy-3-O-methyl-4-C-(1-(2-methyl-1-oxobutoxy)ethyl)-alpha-L-lyxo-hexopyranosyl)-beta-D-allopyranosyl)-2-amino-5-hydroxy-3,6-hydroxy-3,6-dioxo-1-cyclohexene-1-carboxylic acid
  • L-Cysteine, N-acetyl-, (2-((2-(acetylamino)-2-carboxyethyl)thio)-1-carboxypropyl)carbamodithioate(ester), 4'-ester with 5-(6-O-acetyl-3-O-(2,6-dideoxy-3-O-methyl-4-C-(1-(2-methyl-1-oxobutoxy)ethyl)-alpha-L-lyxo-hexopyranosyl)-beta-D-allopyranosyl)-2-amino-5-hydroxy-3,6-dioxo-1-cyclohexene-1-carboxylic acid
  • (3S)-3-((2R,3R,4S,5R,6R)-5-(3-((2R)-2-acetamido-2-carboxyethyl)sulfanyl-2-(((2R)-2-acetamido-2-carboxyethyl)sulfanylcarbothioylamino)butanoyl)oxy-6-(acetyloxymethyl)-3-hydroxy-4-((4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-5-((1S)-1-((2S)-2-methylbutanoyl)oxyethyl)oxan-2-yl)oxyoxan-2-yl)-2,3-dihydroxy-6-imino-5-oxocyclohexene-1-carboxylic acid
  • (5S)-5-[(2R,3R,4S,5R,6R)-5-[3-[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]sulfanyl-2-[[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]sulfanylcarbothioylamino]butanoyl]oxy-6-(acetyloxymethyl)-3-hydroxy-4-[(4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-5-[(1S)-1-[(2S)-2-methylbutanoyl]oxyethyl]oxan-2-yl]oxyoxan-2-yl]-2-amino-5-hydroxy-3,6-dioxocyclohexene-1-carboxylic acid